Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)- supplier

Name
Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-
EINECS
CAS No. 54609-09-5
Density 1.06 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₃NO
Boiling Point 334.8 °C at 760 mmHg
Molecular Weight 187.241
Flash Point 156.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(2,5-Dimethyl-1H-pyrrol-1-yl)phenol;1-(4-Hydroxyphenyl)-2,5-dimethylpyrrole;Phenol, p-(2,5-dimethylpyrrol-1-yl)- (7CI);
PSA
LogP

Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)- Specification

The Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-, with the CAS registry number 54609-09-5, is also known as 1-(4-Hydroxyphenyl)-2,5-dimethylpyrrole. This chemical's molecular formula is C₁₂H₁₃NO and molecular weight is 187.24. What's more, its systematic name is 4-(2,5-Dimethyl-1H-pyrrol-1-yl)phenol.

Physical properties of Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)- are: (1)ACD/LogP: 3.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.26; (4)ACD/LogD (pH 7.4): 3.25; (5)ACD/BCF (pH 5.5): 177.99; (6)ACD/BCF (pH 7.4): 174.34; (7)ACD/KOC (pH 5.5): 1420.39; (8)ACD/KOC (pH 7.4): 1391.28; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 14.16 Å²; (13)Index of Refraction: 1.567; (14)Molar Refractivity: 57.18 cm³; (15)Molar Volume: 175 cm³; (16)Polarizability: 22.67×10^-24cm³; (17)Surface Tension: 37.3 dyne/cm; (18)Density: 1.06 g/cm³; (19)Flash Point: 156.3 °C; (20)Enthalpy of Vaporization: 60.07 kJ/mol; (21)Boiling Point: 334.8 °C at 760 mmHg; (22)Vapour Pressure: 6.42E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1)n2c(ccc2C)C
(2)InChI: InChI=1/C12H13NO/c1-9-3-4-10(2)13(9)11-5-7-12(14)8-6-11/h3-8,14H,1-2H3
(3)InChIKey: GQGLLBKGZRMFGZ-UHFFFAOYSA-N

Product Name

Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-

Phenol, 4-(2,5-dimethyl-1H-pyrrol-1-yl)- Specification

Related Products

Hot Products